5-cyclohexyl-1-(2-methylphenyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-cyclohexyl-1-(2-methylphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cyclohexyl-1-(o-tolyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cyclohexyl-1-(2-methylphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cyclohexyl-1-(2-methylphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cyclohexyl-1-(o-tolyl)-1,3,5-triazinan-5-ium-2-thione Formula: C16H24N3S+ MolecularWeight: 290.44686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C[NH+](CNC2=S)C3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1N2C[NH+](CNC2=S)C3CCCCC3

InChI

InChI=1S/C16H23N3S/c1-13-7-5-6-10-15(13)19-12-18(11-17-16(19)20)14-8-3-2-4-9-14/h5-7,10,14H,2-4,8-9,11-12H2,1H3,(H,17,20)/p+1